4-[3-[butyl(cyclopropylmethyl)amino]-1-thiophen-3-yl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[butyl(cyclopropylmethyl)amino]-1-thiophen-3-yl-propoxy]benzenecarbonitrile Openeye Name: 4-[3-[butyl(cyclopropylmethyl)amino]-1-(3-thienyl)propoxy]benzonitrile CAS Name: 4-[3-[butyl(cyclopropylmethyl)amino]-1-(3-thiophenyl)propoxy]benzonitrile IUPAC Name: 4-[3-[butyl(cyclopropylmethyl)amino]-1-thiophen-3-ylpropoxy]benzonitrile Traditional Name: 4-[3-[butyl(cyclopropylmethyl)amino]-1-(3-thienyl)propoxy]benzonitrile Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(C1=CSC=C1)OC2=CC=C(C=C2)C#N)CC3CC3

Isomeric SMILES

CCCCN(CCC(C1=CSC=C1)OC2=CC=C(C=C2)C#N)CC3CC3

InChI

InChI=1S/C22H28N2OS/c1-2-3-12-24(16-19-4-5-19)13-10-22(20-11-14-26-17-20)25-21-8-6-18(15-23)7-9-21/h6-9,11,14,17,19,22H,2-5,10,12-13,16H2,1H3